Chlorobutanol

Chlorobutanol

SCHEMBL4557423

CC(C)(O)C(Cl)(Cl)Cl.CCCC(O)Cl

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.48
FDPS P14324 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Tert-Butanol SCHEMBL28284358 0.85 TSHR (0.32)
SCHEMBL5719652 0.82 TSHR (0.38) FDPS
SCHEMBL13198079 0.82
SCHEMBL1042 0.82
SCHEMBL28044604 0.79
Hydrochloric Acid SCHEMBL7323438 0.79
Ammonia Solution, Strong SCHEMBL9221280 0.79
Water SCHEMBL5484486 0.79
Hydrochloric Acid SCHEMBL3099736 0.76
SCHEMBL4636908 0.74 TRPA1 (0.31) FDPS

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8636988-B2 Composition for treatment of sunburned skin Doctor Essentials (US) 2014-01-28 US disclosed
US-20090196840-A1 COMPOSITION FOR TREATMENT OF SUNBURNED SKIN DOCTORS ESSENTIALS (US) 2009-08-06 US disclosed
EP-1692279-A4 PRESERVATIVE-CONTAINING VIRUS FORMULATIONS MERCK & CO INC (US) 2006-12-27 EP disclosed
EP-1692279-A2 PRESERVATIVE-CONTAINING VIRUS FORMULATIONS Merck & Co., Inc. (US) 2006-08-23 EP disclosed
WO-2005052116-A2 PRESERVATIVE-CONTAINING VIRUS FORMULATIONS MERCK & CO., INC. (US) 2005-06-09 WO disclosed